difluoro(1-phenylpropyl)silane

C9H12F2Si — CID 173017282

IUPACdifluoro(1-phenylpropyl)silane
SMILESCCC(c1ccccc1)[SiH](F)F
InChIInChI=1S/C9H12F2Si/c1-2-9(12(10)11)8-6-4-3-5-7-8/h3-7,9,12H,2H2,1H3
InChIKeyWYYNCCCRZFTZPY-UHFFFAOYSA-N
MW186.28 g/mol
LogP2.88
Rot. Bonds3

About difluoro(1-phenylpropyl)silane

difluoro(1-phenylpropyl)silane (PubChem CID 173017282) has the molecular formula C9H12F2Si and a molecular weight of 186.28 g/mol. Its IUPAC name is difluoro(1-phenylpropyl)silane.

Molecular Properties

Compound Namedifluoro(1-phenylpropyl)silane
PubChem CID173017282
Molecular FormulaC9H12F2Si
Molecular Weight186.28 g/mol
Exact Mass186.07
IUPAC Namedifluoro(1-phenylpropyl)silane
SMILESCCC(c1ccccc1)[SiH](F)F
InChIInChI=1S/C9H12F2Si/c1-2-9(12(10)11)8-6-4-3-5-7-8/h3-7,9,12H,2H2,1H3
InChIKeyWYYNCCCRZFTZPY-UHFFFAOYSA-N
XLogP2.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

Analyze difluoro(1-phenylpropyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-phenylpropyl(dipropoxy)silane
CID 173016700
azane;pentan-3-ylbenzene
CID 19774895
1-(trifluoromethoxy)propylbenzene
CID 174717015
ethane;2-fluorobutane;1-phenylethylbenzene
CID 142933891
[(2S)-1,1-diphenylbutan-2-yl]benzene
CID 101326862
dichloro(1-phenylpentyl)silane
CID 173039565
6,6-diphenylhexan-3-ol
CID 57258566
[(2R,3S)-3-methylpentan-2-yl]benzene
CID 142488362
1-phenylpropan-1-ol;hydrate
CID 156782934
(1S)-1-phenylpropan-1-amine;hydrochloride
CID 44542268
2,2-difluoro-1-phenylbutan-1-ol
CID 15783630
(1-fluoro-1-phenylpentan-3-yl)benzene
CID 150013028

Frequently Asked Questions

What is the IUPAC name of difluoro(1-phenylpropyl)silane?
The IUPAC name of difluoro(1-phenylpropyl)silane (CID 173017282) is difluoro(1-phenylpropyl)silane.
What is the SMILES notation for difluoro(1-phenylpropyl)silane?
The canonical SMILES for difluoro(1-phenylpropyl)silane is CCC(c1ccccc1)[SiH](F)F.
What is the InChIKey of difluoro(1-phenylpropyl)silane?
The InChIKey is WYYNCCCRZFTZPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2Si/c1-2-9(12(10)11)8-6-4-3-5-7-8/h3-7,9,12H,2H2,1H3.
What are the key properties of difluoro(1-phenylpropyl)silane?
difluoro(1-phenylpropyl)silane has a molecular weight of 186.28 g/mol, XLogP of 2.88, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro(1-phenylpropyl)silane is sourced from PubChem (CID 173017282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).